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Umangite |
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Milman V |
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Acta Crystallographica B58 (2002) 437-447 |
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Klockmannite, CuSe: structure, properties and phase stability from ab initio |
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modeling |
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Locality: hypothetical structure calculated using DFT |
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_database_code_amcsd 0009926 |
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6.308 6.308 4.350 90 90 90 P-42_1m |
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atom x y z |
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Cu1 0 0 0 |
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Cu2 .6430 .8570 .2475 |
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Se .2655 .7655 .2586 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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Umangite |
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Heyding R D, Murray R M |
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Canadian Journal of Chemistry 54 (1976) 841-848 |
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Crystal structures of Cu1.8Se, Cu3Se2, alpha- and gamma=CuSe, CuSe2, and CuSe2II |
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Locality: Beaverlodge Region, Saskatchewan, Canada |
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_database_code_amcsd 0012164 |
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6.4024 6.4024 4.2786 90 90 90 P-42_1m |
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atom x y z Biso |
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Cu1 0 0 0 2.3 |
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Cu2 .647 .853 .219 2.3 |
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Se .272 .772 .264 1.9 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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